Coupled-cluster theory for the polarizable continuum model. III. A response theory for molecules in solution

R. Cammi

doi:10.1002/qua.23271

Coupled-cluster theory for the polarizable continuum model. III. A response theory for molecules in solution

International Journal of Quantum Chemistry ◽

10.1002/qua.23271 ◽

2012 ◽

Vol 112 (13) ◽

pp. 2547-2560 ◽

Cited By ~ 26

Author(s):

R. Cammi

Keyword(s):

Continuum Model ◽

Polarizable Continuum Model ◽

Coupled Cluster ◽

Response Theory ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Polarizable Continuum

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Coupled cluster theory with the polarizable continuum model of solvation

International Journal of Quantum Chemistry ◽

10.1002/qua.25710 ◽

2018 ◽

Vol 119 (1) ◽

pp. e25710 ◽

Cited By ~ 5

Author(s):

Marco Caricato

Keyword(s):

Continuum Model ◽

Polarizable Continuum Model ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Polarizable Continuum

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On Two Recent Developments in the Description of Molecular Properties in Solution by Using the Polarizable Continuum Model (PCM): The Coupled-Cluster Theory and the Molecules at Extreme Pressures

Practical Aspects of Computational Chemistry II ◽

10.1007/978-94-007-0923-2_1 ◽

2012 ◽

pp. 1-17 ◽

Cited By ~ 1

Author(s):

R. Cammi

Keyword(s):

Continuum Model ◽

Polarizable Continuum Model ◽

Molecular Properties ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Recent Developments ◽

Polarizable Continuum

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Linear response coupled cluster theory with the polarizable continuum model within the singles approximation for the solvent response

The Journal of Chemical Physics ◽

10.1063/1.5021781 ◽

2018 ◽

Vol 148 (13) ◽

pp. 134113 ◽

Cited By ~ 6

Author(s):

Marco Caricato

Keyword(s):

Linear Response ◽

Continuum Model ◽

Polarizable Continuum Model ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Polarizable Continuum

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Applications of core-valence extensive multi-reference coupled cluster theory and core-extensive coupled cluster-based linear response theory

Journal of Molecular Structure THEOCHEM ◽

10.1016/j.theochem.2006.05.015 ◽

2006 ◽

Vol 768 (1-3) ◽

pp. 133-140 ◽

Cited By ~ 4

Author(s):

Malaya K. Nayak ◽

Rajat K. Chaudhuri ◽

Sudip Chattopadhyay ◽

Uttam Sinha Mahapatra

Keyword(s):

Linear Response ◽

Linear Response Theory ◽

Coupled Cluster ◽

Response Theory ◽

Coupled Cluster Theory ◽

Cluster Theory

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On the Importance of the Orbital Relaxation in Ground-State Coupled Cluster Calculations in Solution with the Polarizable Continuum Model of Solvation

Journal of Chemical Theory and Computation ◽

10.1021/ct2006677 ◽

2011 ◽

Vol 7 (12) ◽

pp. 4012-4018 ◽

Cited By ~ 8

Author(s):

Marco Caricato ◽

Giovanni Scalmani

Keyword(s):

Ground State ◽

Continuum Model ◽

Polarizable Continuum Model ◽

Coupled Cluster ◽

Cluster Calculations ◽

Orbital Relaxation ◽

Polarizable Continuum ◽

Coupled Cluster Calculations

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Quantum Cluster Theory for the Polarizable Continuum Model (PCM)

Handbook of Computational Chemistry ◽

10.1007/978-94-007-0711-5_28 ◽

2012 ◽

pp. 1043-1066 ◽

Cited By ~ 1

Author(s):

Roberto Cammi ◽

Jacopo Tomasi

Keyword(s):

Continuum Model ◽

Polarizable Continuum Model ◽

Cluster Theory ◽

Quantum Cluster ◽

Polarizable Continuum

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Linear response theory for the polarizable continuum model

The Journal of Chemical Physics ◽

10.1063/1.478861 ◽

1999 ◽

Vol 110 (20) ◽

pp. 9877-9886 ◽

Cited By ~ 211

Author(s):

Roberto Cammi ◽

Benedetta Mennucci

Keyword(s):

Linear Response ◽

Continuum Model ◽

Linear Response Theory ◽

Polarizable Continuum Model ◽

Response Theory ◽

Polarizable Continuum

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Recent Advances in the Coupled-Cluster Analytical Derivatives Theory for Molecules in Solution Described With the Polarizable Continuum Model (PCM)

Advances in Quantum Chemistry Volume 64 - Advances in Quantum Chemistry ◽

10.1016/b978-0-12-396498-4.00001-6 ◽

2012 ◽

pp. 1-29 ◽

Cited By ~ 4

Author(s):

Roberto Cammi

Keyword(s):

Continuum Model ◽

Polarizable Continuum Model ◽

Coupled Cluster ◽

Recent Advances ◽

Analytical Derivatives ◽

Polarizable Continuum

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Brueckner doubles coupled cluster method with the polarizable continuum model of solvation

The Journal of Chemical Physics ◽

10.1063/1.3604560 ◽

2011 ◽

Vol 134 (24) ◽

pp. 244113 ◽

Cited By ~ 19

Author(s):

Marco Caricato ◽

Giovanni Scalmani ◽

Michael J. Frisch

Keyword(s):

Continuum Model ◽

Polarizable Continuum Model ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method ◽

Polarizable Continuum

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Excited-state polarizabilities of solvated molecules using cubic response theory and the polarizable continuum model

The Journal of Chemical Physics ◽

10.1063/1.3291026 ◽

2010 ◽

Vol 132 (2) ◽

pp. 024107 ◽

Cited By ~ 8

Author(s):

Lara Ferrighi ◽

Luca Frediani ◽

Kenneth Ruud

Keyword(s):

Excited State ◽

Continuum Model ◽

Polarizable Continuum Model ◽

Response Theory ◽

Solvated Molecules ◽

Polarizable Continuum

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